CID 4471435

N-benzhydryl-n'-phenylurea

Structural Information

Molecular Formula
C20H18N2O
SMILES
C1=CC=C(C=C1)C(C2=CC=CC=C2)NC(=O)NC3=CC=CC=C3
InChI
InChI=1S/C20H18N2O/c23-20(21-18-14-8-3-9-15-18)22-19(16-10-4-1-5-11-16)17-12-6-2-7-13-17/h1-15,19H,(H2,21,22,23)
InChIKey
FFSMGGLZCZRZHB-UHFFFAOYSA-N
Compound name
1-benzhydryl-3-phenylurea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

3
Patents

302.1419 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 303.14918 170.9
[M+Na]+ 325.13112 174.1
[M-H]- 301.13462 179.6
[M+NH4]+ 320.17572 183.9
[M+K]+ 341.10506 169.1
[M+H-H2O]+ 285.13916 161.2
[M+HCOO]- 347.14010 194.9
[M+CH3COO]- 361.15575 181.0
[M+Na-2H]- 323.11657 176.8
[M]+ 302.14135 167.2
[M]- 302.14245 167.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe